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2-heptadecyl-1H-imidazole; nickel(2+); octanoate

2-heptadecyl-1H-imidazole; nickel(2+); octanoate

Systemtic Name:2-heptadecyl-1H-imidazole; nickel(2+); octanoate
Openeye Name:nickelous; 2-heptadecyl-1H-imidazole; octanoate
CAS Name:2-heptadecyl-1H-imidazole; nickel(2+); octanoate
IUPAC Name:2-heptadecyl-1H-imidazole; nickel(2+); octanoate
Traditional Name:nickelous; caprylate; 2-heptadecyl-1H-imidazole
Formula: C56H106N4NiO4
MolecularWeight: 958.15864
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC1=NC=CN1.CCCCCCCCCCCCCCCCCC1=NC=CN1.CCCCCCCC(=O)[O-].CCCCCCCC(=O)[O-].[Ni+2]


Isomeric SMILES

CCCCCCCCCCCCCCCCCC1=NC=CN1.CCCCCCCCCCCCCCCCCC1=NC=CN1.CCCCCCCC(=O)[O-].CCCCCCCC(=O)[O-].[Ni+2]


InChI

InChI=1S/2C20H38N2.2C8H16O2.Ni/c2*1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-21-18-19-22-20;2*1-2-3-4-5-6-7-8(9)10;/h2*18-19H,2-17H2,1H3,(H,21,22);2*2-7H2,1H3,(H,9,10);/q;;;;+2/p-2


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